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3-Hydroxy-3-p-tolylhex-5-enedithioic acid methyl ester
SpectraBase Compound ID KJp7IruJfek
InChI InChI=1S/C14H18OS2/c1-4-9-14(15,10-13(16)17-3)12-7-5-11(2)6-8-12/h4-8,15H,1,9-10H2,2-3H3
InChIKey VCWLBKPAXPYZPR-UHFFFAOYSA-N
Mol Weight 266.42 g/mol
Molecular Formula C14H18OS2
Exact Mass 266.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7E0KwaRSTSr
Name 3-Hydroxy-3-p-tolylhex-5-enedithioic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18OS2
InChI InChI=1S/C14H18OS2/c1-4-9-14(15,10-13(16)17-3)12-7-5-11(2)6-8-12/h4-8,15H,1,9-10H2,2-3H3
InChIKey VCWLBKPAXPYZPR-UHFFFAOYSA-N
Molecular Weight 266.417 g/mol
SMILES OC(CC(=S)SC)(c1ccc(cc1)C)CC=C
SPLASH splash10-014i-0940000000-2c9a6ac43389be5f411d
Source of Spectrum F-69-8902-1g
Synonyms Methyl 3-hydroxy-3-(p-tolyl)hex-5-enedithioate
Wiley ID 1738312